| SpectraBase Spectrum ID |
9n0uvHJvkel |
| Name |
5-fluoro AMB metabolite 7 RM |
| Catalog Number |
18545 |
| CAS Registry Number |
1890250-19-7 |
| Comments |
inlet temperature 240deg C |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.180169805 u |
| Formula |
C18H24FN3O3 |
| InChI |
InChI=1S/C18H24FN3O3/c1-12(2)15(18(24)25)20-17(23)16-13-8-4-5-9-14(13)22(21-16)11-7-3-6-10-19/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3,(H,20,23)(H,24,25)/t15-/m0/s1 |
| InChIKey |
FGTPKIQXNMGJLF-HNNXBMFYSA-N |
| Molecular Weight |
349.406 g/mol |
| Purity |
>=98% |
| Quality |
419 |
| SMILES |
N(C(C1=NN(C2=CC=CC=C12)CCCCCF)=O)[C@](C(O)=O)(C(C)C)[H] |
| SPLASH |
splash10-001j-5952000000-1d21917c26cb2f22bdab |
| Source of Spectrum |
CAY-2024-1174-0 |
| Synonyms |
(2S)-2-{[1-(5-fluoropentyl)-1H-indazol-3-yl]formamido}-3-methylbutanoic acid |
| Wiley ID |
1890549 |
